1-butyl-2,3-dimethyl-indole-5-carboxylic acid

Systemtic Name: 1-butyl-2,3-dimethyl-indole-5-carboxylic acid Openeye Name: 1-butyl-2,3-dimethyl-indole-5-carboxylic acid CAS Name: 1-butyl-2,3-dimethyl-5-indolecarboxylic acid IUPAC Name: 1-butyl-2,3-dimethylindole-5-carboxylic acid Traditional Name: 1-butyl-2,3-dimethyl-indole-5-carboxylic acid Formula: C15H19NO2 MolecularWeight: 245.31686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=C1C=CC(=C2)C(=O)O)C)C

Isomeric SMILES

CCCCN1C(=C(C2=C1C=CC(=C2)C(=O)O)C)C

InChI

InChI=1S/C15H19NO2/c1-4-5-8-16-11(3)10(2)13-9-12(15(17)18)6-7-14(13)16/h6-7,9H,4-5,8H2,1-3H3,(H,17,18)